N-[3-(butylsulfanyl)propyl]-6-[(3,5-dimethylphenyl)sulfamoyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
N-[3-(butylsulfanyl)propyl]-6-[(3,5-dimethylphenyl)sulfamoyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
N-[3-(butylsulfanyl)propyl]-6-[(3,5-dimethylphenyl)sulfamoyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | K788-4233 |
| Compound Name: | N-[3-(butylsulfanyl)propyl]-6-[(3,5-dimethylphenyl)sulfamoyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide |
| Molecular Weight: | 501.67 |
| Molecular Formula: | C25 H31 N3 O4 S2 |
| Smiles: | CCCCSCCCNC(C1=CNc2ccc(cc2C1=O)S(Nc1cc(C)cc(C)c1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1475 |
| logD: | 3.0865 |
| logSw: | -4.2418 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.534 |
| InChI Key: | IKFOPYBKCUNXGY-UHFFFAOYSA-N |